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]+ 153.12740 135.6
[M+Na]+ 175.10934 141.9
[M-H]- 151.11284 139.4
[M+NH4]+ 170.15394 157.4
[M+K]+ 191.08328 141.1
[M+H-H2O]+ 135.11738 130.9
[M+HCOO]- 197.11832 156.3
[M+CH3COO]- 211.13397 176.7
[M+Na-2H]- 173.09479 138.2
[M]+ 152.11957 134.0
[M]- 152.12067 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.