CID 3559861

Curcumo

Structural Information

Molecular Formula
C15H24O2
SMILES
CC1CCC2C13CC(C(O3)(CC2=C)O)C(C)C
InChI
InChI=1S/C15H24O2/c1-9(2)13-8-14-11(4)5-6-12(14)10(3)7-15(13,16)17-14/h9,11-13,16H,3,5-8H2,1-2,4H3
InChIKey
QRMPRVXWPCLVNI-UHFFFAOYSA-N
Compound name
2-methyl-6-methylidene-9-propan-2-yl-11-oxatricyclo[6.2.1.01,5]undecan-8-ol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

145
References

1468
Patents

236.17763 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.18491 157.2
[M+Na]+ 259.16685 164.0
[M-H]- 235.17035 160.6
[M+NH4]+ 254.21145 183.1
[M+K]+ 275.14079 161.0
[M+H-H2O]+ 219.17489 154.4
[M+HCOO]- 281.17583 170.6
[M+CH3COO]- 295.19148 192.0
[M+Na-2H]- 257.15230 158.3
[M]+ 236.17708 155.0
[M]- 236.17818 155.0
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

patents stripe