CIS-3-NONEN-1-OL(10340-23-5) MS
Product NameCIS-3-NONEN-1-OL
CAS10340-23-5
Molecular FormulaC9H18O
Molecular Weight142.24
InChIInChI=1S/C9H18O/c1-2-3-4-5-6-7-8-9-10/h6-7,10H,2-5,8-9H2,1H3/b7-6-
InChIKey IFTBJDZSLBRRMC-SREVYHEPSA-N
SmilesC(O)C/C=C\CCCCC
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MassMS-IW-6646 cis-3-nonen-1-ol C9H18O (Mass of molecular ion: 142)
Source Temperature: 210 °C Sample Temperature: 150 °C Reservoir, 75 eV
18.0 3.4 27.0 20.0 28.0 5.7 29.0 33.1 30.0 1.0 31.0 17.8 39.0 26.0 40.0 4.3 41.0 85.8 42.0 23.4 43.0 28.0 44.0 8.2 45.0 2.7 50.0 1.0 51.0 2.9 52.0 1.7 53.0 16.9 54.0 52.1 55.0 100.0 56.0 28.4 57.0 32.8 58.0 2.9 65.0 4.4 66.0 8.0 67.0 80.6 68.0 97.9 69.0 72.5 70.0 25.5 71.0 12.0 72.0 1.9 77.0 3.6 79.0 12.3 80.0 3.1 81.0 86.3 82.0 56.2 83.0 16.0 84.0 3.9 85.0 2.3 86.0 1.0 91.0 1.1 93.0 1.8 94.0 1.1 95.0 46.7 96.0 25.4 97.0 3.3 98.0 3.5 99.0 1.9 109.0 4.9 114.0 1.3 124.0 24.9 125.0 2.5 142.0 1.0
400 MHz in CDCl3
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1H NMR 399.65 MHz C9 H18 O 0.05 ml : 0.5 ml CDCl3 cis-3-nonen-1-ol 
Assign. Shift(ppm)
A 5.543 B 5.364 C 3.623 D 2.322 E 2.28 F 2.062 G 1.35 J 1.30 K 0.887
Hz ppm Int.2230.35 5.581 36 2228.88 5.578 61 2227.42 5.574 36 2223.02 5.563 76 2221.56 5.559 124 2219.97 5.555 91 2218.02 5.550 88 2216.43 5.546 65 2214.23 5.541 75 2212.28 5.536 107 2210.69 5.532 162 2209.23 5.528 91 2204.83 5.517 52 2203.37 5.514 85 2202.03 5.510 48 2157.35 5.399 50 2155.88 5.395 82 2154.30 5.391 47 2150.02 5.380 97 2148.44 5.376 162 2146.85 5.372 107 2145.02 5.368 70 2142.82 5.362 65 2141.11 5.358 93 2139.28 5.353 98 2137.57 5.349 123 2136.11 5.345 68 2131.84 5.335 37 2130.25 5.331 62 2128.66 5.327 33 1454.83 3.641 495 1448.24 3.624 937 1441.53 3.607 505 932.50 2.334 317 931.88 2.332 348 931.15 2.330 342 925.17 2.315 353 924.56 2.314 345 923.83 2.312 311 832.28 2.083 102 825.68 2.067 268 818.97 2.050 281 811.77 2.032 118 542.36 1.358 242 527.83 1.321 254 521.97 1.307 350 519.04 1.299 590 515.87 1.291 380 512.21 1.282 288 361.69 0.906 413 354.86 0.888 1000 347.90 0.871 434
in CDCl3
liquid film
