CID 14433088

3beta-7-drimene-3,11-diol

Structural Information

Molecular Formula
C15H26O2
SMILES
CC1=CCC2C(C(CCC2(C1CO)C)O)(C)C
InChI
InChI=1S/C15H26O2/c1-10-5-6-12-14(2,3)13(17)7-8-15(12,4)11(10)9-16/h5,11-13,16-17H,6-9H2,1-4H3
InChIKey
SYSFCGLKPBVTDQ-UHFFFAOYSA-N
Compound name
5-(hydroxymethyl)-1,1,4a,6-tetramethyl-2,3,4,5,8,8a-hexahydronaphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

238.19328 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.200556 156.4
[M+Na]+ 261.182498 163.4
[M-H]- 237.186004 158.1
[M+NH4]+ 256.227103 178.6
[M+K]+ 277.156438 160.0
[M+H-H2O]+ 221.190540 152.5
[M+HCOO]- 283.191481 170.3
[M+CH3COO]- 297.207131 191.2
[M+Na-2H]- 259.167946 159.5
[M]+ 238.19273142 153.0
[M]- 238.19382858 153.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.