CID 12302239

25330-21-6

Structural Information

Molecular Formula
C15H26O2
SMILES
CC(C)C1CCC(C2C1(CC(=C)CC2)O)(C)O
InChI
InChI=1S/C15H26O2/c1-10(2)12-7-8-14(4,16)13-6-5-11(3)9-15(12,13)17/h10,12-13,16-17H,3,5-9H2,1-2,4H3
InChIKey
AHNGXHRYFGQWSL-UHFFFAOYSA-N
Compound name
1-methyl-6-methylidene-4-propan-2-yl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1,4a-diol
Related CIDs

2D Structure

compound 2d structure
1
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]+ 239.20056 158.4
[M+Na]+ 261.18250 167.5
[M+NH4]+ 256.22710 169.4
[M+K]+ 277.15644 158.1
[M-H]- 237.18600 159.5
[M+Na-2H]- 259.16795 162.6
[M]+ 238.19273 160.1
[M]- 238.19383 160.1
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

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