SpectraBase Spectrum ID |
4mdpAZce1Em |
Name |
Pinene hydrate |
CAS Registry Number |
4948-28-1 |
Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
Exact Mass |
154.135765199 u |
Formula |
C10H18O |
GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
InChI |
InChI=1S/C10H18O/c1-9(2)7-4-5-10(3,11)8(9)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8+,10-/m0/s1 |
InChIKey |
YYWZKGZIIKPPJZ-XKSSXDPKSA-N |
Molecular Weight |
154.253 g/mol |
Nominal Mass |
154 u |
Number of Peaks |
94 |
SMILES |
O[C@]1(CC[C@@]2(C([C@]1(C2)[H])(C)C)[H])C |
SPLASH |
splash10-0006-9000000000-812b92a3162f81bc68e1 |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
RA001121 |