CID 91694343

Dtxsid70880699

Structural Information

Molecular Formula
C10H18
SMILES
C[C@@H]1[C@@H](C1=C(C)C)C(C)C
InChI
InChI=1S/C10H18/c1-6(2)9-8(5)10(9)7(3)4/h6,8-9H,1-5H3/t8-,9+/m1/s1
InChIKey
YMHRHZGFRVCIFH-BDAKNGLRSA-N
Compound name
cis-(1R,2S)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.14085 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.148126 129.4
[M+Na]+ 161.130068 138.7
[M-H]- 137.133574 134.6
[M+NH4]+ 156.174673 147.1
[M+K]+ 177.104008 136.6
[M+H-H2O]+ 121.138110 124.3
[M+HCOO]- 183.139051 150.7
[M+CH3COO]- 197.154701 183.5
[M+Na-2H]- 159.115516 131.8
[M]+ 138.14030142 132.1
[M]- 138.14139858 132.1
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.