CID 131751905

Marmelo oxide a

Structural Information

Molecular Formula
C10H16O
SMILES
CC1CC(OC1)/C=C\C(=C)C
InChI
InChI=1S/C10H16O/c1-8(2)4-5-10-6-9(3)7-11-10/h4-5,9-10H,1,6-7H2,2-3H3/b5-4-
InChIKey
SULWOTZUSYCRIP-PLNGDYQASA-N
Compound name
4-methyl-2-[(1Z)-3-methylbuta-1,3-dienyl]oxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.12012 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.127396 135.6
[M+Na]+ 175.109338 141.9
[M-H]- 151.112844 139.4
[M+NH4]+ 170.153943 157.4
[M+K]+ 191.083278 141.1
[M+H-H2O]+ 135.117380 130.9
[M+HCOO]- 197.118321 156.3
[M+CH3COO]- 211.133971 176.7
[M+Na-2H]- 173.094786 138.2
[M]+ 152.11957142 134.0
[M]- 152.12066858 134.0
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.