CID 6366652

1-(2-(1-metilbutil)crotonil)urea [italian]

Structural Information

Molecular Formula
C10H18N2O2
SMILES
CCCC(C)/C(=C\C)/C(=O)NC(=O)N
InChI
InChI=1S/C10H18N2O2/c1-4-6-7(3)8(5-2)9(13)12-10(11)14/h5,7H,4,6H2,1-3H3,(H3,11,12,13,14)/b8-5+
InChIKey
KSXJYGKGCRJJKP-VMPITWQZSA-N
Compound name
(2E)-N-carbamoyl-2-ethylidene-3-methylhexanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.13683 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.14411 149.4
[M+Na]+ 221.12605 155.1
[M+NH4]+ 216.17065 154.4
[M+K]+ 237.09999 152.2
[M-H]- 197.12955 147.4
[M+Na-2H]- 219.11150 149.5
[M]+ 198.13628 148.9
[M]- 198.13738 148.9
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.